SCHEMBL2017258

SCHEMBL2017258

NCC1CCC(CN)N1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2014665 0.87 CYP2C9 (0.32)
SCHEMBL4368152 0.86
Hydrochloric Acid SCHEMBL10749226 0.84 CYP2C9 (0.30)
SCHEMBL4369973 0.82 S1PR2 (0.38)
SCHEMBL24954889 0.80
SCHEMBL19539549 0.80
SCHEMBL4368204 0.80
SCHEMBL24857249 0.76
SCHEMBL25362077 0.76 GLA (0.33)
SCHEMBL4373236 0.76

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738647-B2 Methods for the synthesis of polycyclic guanidine compounds SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2017-08-22 US claimed
US-20140194622-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2014-07-10 US claimed
US-20120259112-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2012-10-11 US claimed
US-9738647-B2 Methods for the synthesis of polycyclic guanidine compounds SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2017-08-22 US disclosed
US-9738647-B2 Methods for the synthesis of polycyclic guanidine compounds SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2017-08-22 US disclosed
EP-2515648-B1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER INC (US) 2017-08-16 EP disclosed
EP-2515648-B1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER INC (US) 2017-08-16 EP disclosed
US-20150196586-A1 POLYMERIC MOLECULAR RECEPTORS AS PHOSPHATE SEQUESTRANTS GENZYME CORPORATION 2015-07-16 US disclosed
US-8986669-B2 Method for removing phosphate and polymer used therefore GENZYME CORPORATION (US) 2015-03-24 US disclosed
US-20140194622-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2014-07-10 US disclosed
US-20140194622-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2014-07-10 US disclosed
US-8642771-B2 Methods for the synthesis of polycyclic guanidine compounds NOVOMER, INC. (US) 2014-02-04 US disclosed
US-8642771-B2 Methods for the synthesis of polycyclic guanidine compounds NOVOMER, INC. (US) 2014-02-04 US disclosed
EP-2515648-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS Novomer, Inc. (US) 2012-10-31 EP disclosed
US-20120259112-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2012-10-11 US disclosed
WO-2011079041-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2011-06-30 WO disclosed
WO-2011079041-A1 METHODS FOR THE SYNTHESIS OF POLYCYCLIC GUANIDINE COMPOUNDS NOVOMER, INC. (US) 2011-06-30 WO disclosed
EP-0250358-A2 Novel complex compounds SCHERING AKTIENGESELLSCHAFT (DE) 1987-12-23 EP disclosed